2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide

C22H45N4OP — CID 20547111

IUPAC2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide
SMILESCC1CN(C2CC(C)(C)NC(C)(C)C2)P(C)(=O)N1C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C22H45N4OP/c1-16-15-25(17-11-19(2,3)23-20(4,5)12-17)28(10,27)26(16)18-13-21(6,7)24-22(8,9)14-18/h16-18,23-24H,11-15H2,1-10H3
InChIKeyHFGLLUKMBCIHFM-UHFFFAOYSA-N
MW412.60 g/mol
LogP4.43
Rot. Bonds2

About 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide

2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide (PubChem CID 20547111) has the molecular formula C22H45N4OP and a molecular weight of 412.60 g/mol. Its IUPAC name is 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide.

Molecular Properties

Compound Name2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide
PubChem CID20547111
Molecular FormulaC22H45N4OP
Molecular Weight412.60 g/mol
Exact Mass412.33
IUPAC Name2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide
SMILESCC1CN(C2CC(C)(C)NC(C)(C)C2)P(C)(=O)N1C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C22H45N4OP/c1-16-15-25(17-11-19(2,3)23-20(4,5)12-17)28(10,27)26(16)18-13-21(6,7)24-22(8,9)14-18/h16-18,23-24H,11-15H2,1-10H3
InChIKeyHFGLLUKMBCIHFM-UHFFFAOYSA-N
XLogP4.43
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.60
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2-methyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide
CID 20547116
2,2,6,6-tetramethyl-4-[2-methyl-3-(2,2,6,6-tetramethylpiperidin-4-yl)imidazolidin-1-yl]piperidine
CID 23451962
1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidine-2,6-dione
CID 11615794
(2,2,6,6-tetramethylpiperidin-4-yl)methanimine
CID 91198947
N-tert-butyl-N,2,2,6,6-pentamethylpiperidin-4-amine
CID 90292225
1-(1,2,2,6,6-pentamethylpiperidin-4-yl)pyrrole-2,5-dione;1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrole-2,5-dione
CID 161015472
methane;3-methyl-4-(2-methylbutyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 160516047
3-methyl-4-(2-methylicosyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione;3-methyl-4-(2-methyltetracosyl)-1-(2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
CID 157391169
2-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3-dihydroisoindole
CID 91361054
tetrakis(2,2,6,6-tetramethylpiperidin-4-yl) silicate
CID 18781767
dimethyl-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]silane
CID 579977
2-methyl-1,3-bis(2,2,6,6-tetramethyl-1-prop-2-enylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide
CID 20547117

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide?
The IUPAC name of 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide (CID 20547111) is 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide.
What is the SMILES notation for 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide?
The canonical SMILES for 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide is CC1CN(C2CC(C)(C)NC(C)(C)C2)P(C)(=O)N1C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide?
The InChIKey is HFGLLUKMBCIHFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H45N4OP/c1-16-15-25(17-11-19(2,3)23-20(4,5)12-17)28(10,27)26(16)18-13-21(6,7)24-22(8,9)14-18/h16-18,23-24H,11-15H2,1-10H3.
What are the key properties of 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide?
2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide has a molecular weight of 412.60 g/mol, XLogP of 4.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1,3-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,2λ5-diazaphospholidine 2-oxide is sourced from PubChem (CID 20547111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).